2-[(9R)-3-methoxy-6-oxidanyl-9H-xanthen-9-yl]benzoate

Systemtic Name: 2-[(9R)-3-methoxy-6-oxidanyl-9H-xanthen-9-yl]benzoate Openeye Name: 2-[(9R)-3-hydroxy-6-methoxy-9H-xanthen-9-yl]benzoate CAS Name: 2-[(9R)-3-hydroxy-6-methoxy-9H-xanthen-9-yl]benzoate IUPAC Name: 2-[(9R)-3-hydroxy-6-methoxy-9H-xanthen-9-yl]benzoate Traditional Name: 2-[(9R)-3-hydroxy-6-methoxy-9H-xanthen-9-yl]benzoate Formula: C21H15O5- MolecularWeight: 347.3408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(C3=C(O2)C=C(C=C3)O)C4=CC=CC=C4C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)[C@@H](C3=C(O2)C=C(C=C3)O)C4=CC=CC=C4C(=O)[O-]

InChI

InChI=1S/C21H16O5/c1-25-13-7-9-17-19(11-13)26-18-10-12(22)6-8-16(18)20(17)14-4-2-3-5-15(14)21(23)24/h2-11,20,22H,1H3,(H,23,24)/p-1/t20-/m1/s1